SCHEMBL6596807

SCHEMBL6596807

O=C(Nc1ccc(Cl)cn1)c1cc(Cl)cc(N2CCOCC2)c1NC(=O)c1scc(CNCCN2CCCC2)c1Cl

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 18/20 0.61
F10 P00742 14/20 0.61
KLKB1 P03952 2/20 0.56
ELANE P08246 1/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6591772 0.91 F2 (0.62) F2F10KLKB1ELANE
SCHEMBL6594490 0.89 F2 (0.71) F2F10KLKB1ELANE
SCHEMBL6592354 0.88 F2 (0.71) F2F10KLKB1ELANE
SCHEMBL7696320 0.88 F2 (0.54) F2F10KLKB1ELANE
SCHEMBL6593066 0.87 F2 (0.78) F2F10KLKB1
SCHEMBL6590769 0.87 F2 (0.67) F2F10KLKB1ELANE
SCHEMBL6593186 0.85 F2 (0.65) F2F10KLKB1
SCHEMBL6594794 0.85 F2 (0.76) F2F10KLKB1ELANE
SCHEMBL6590320 0.85 F2 (0.64) F2F10KLKB1
SCHEMBL6591029 0.85 F10 (0.69) F2F10KLKB1ELANE

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1040108-B1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AG (DE) 2004-02-25 EP disclosed
US-6380221-B1 FOR THERAPY OF DISEASE-STATES CHARACTERIZED BY THROMBOTIC ACTIVITY BERLEX LABORATORIES, INC. 2002-04-30 US disclosed
US-6140351-A FOR TREATING THROMBOSIS BERLEX LABORATORIES, INC. (US) 2000-10-31 US disclosed